CID 485476

5-ethyl-10h-indolo[3,2-b]quinolin-5-ium

Structural Information

Molecular Formula
C17H15N2
SMILES
CC[N+]1=C2C3=CC=CC=C3NC2=CC4=CC=CC=C41
InChI
InChI=1S/C17H14N2/c1-2-19-16-10-6-3-7-12(16)11-15-17(19)13-8-4-5-9-14(13)18-15/h3-11H,2H2,1H3/p+1
InChIKey
VPIZPWMUGQPNDN-UHFFFAOYSA-O
Compound name
5-ethyl-10H-indolo[3,2-b]quinolin-5-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

3
Patents

247.12352 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.13080 157.4
[M+Na]+ 270.11274 169.5
[M-H]- 246.11624 161.3
[M+NH4]+ 265.15734 176.5
[M+K]+ 286.08668 156.5
[M+H-H2O]+ 230.12078 152.1
[M+HCOO]- 292.12172 177.7
[M+CH3COO]- 306.13737 170.0
[M+Na-2H]- 268.09819 168.9
[M]+ 247.12297 159.2
[M]- 247.12407 159.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe